NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3795 8.2893 118.1900 55.1942 32.4695 173.7695 2 S 4.7732 8.1797 113.8130 56.4871 66.2456 171.2729 3 H 5.0435 9.6216 117.2488 53.9792 33.5247 174.1636 4 K 4.9985 8.6027 119.5475 54.8676 35.1372 176.0803 5 V 4.5635 9.2968 117.9819 59.8182 36.4488 174.7448 6 T 5.0587 8.3274 111.7873 58.5058 72.3876 174.1857 7 K 3.8428 8.5871 120.6505 59.4140 32.2622 178.4951 8 A 4.0012 7.4560 119.9910 55.1883 18.4229 177.6390 9 H 4.7084 8.3034 111.8620 55.5785 28.8730 174.4857 10 N 4.0002 8.0198 119.6211 55.2924 38.8208 175.2649 11 G 3.9419 9.1194 115.2962 45.0311 0.0000 173.3839 12 A 4.2997 8.1428 122.1297 52.2886 19.8581 176.3925 13 T 5.0424 8.3830 115.8666 61.8756 70.7823 173.9524 14 L 4.7090 8.9205 126.4986 53.3419 44.3679 175.5367 15 T 4.8644 8.4074 120.0597 62.6478 69.6577 174.4814 16 V 4.6207 8.7834 118.6418 59.6569 36.9489 174.1672 17 A 4.8705 8.6971 122.9714 50.1682 21.1585 177.1279 18 V 3.7611 8.3156 120.3586 64.7138 31.9662 176.6539 19 G 4.0376 9.3701 115.9647 45.0765 0.0000 173.4569 20 E 4.3488 8.1269 119.7074 55.9418 31.3142 175.3817 21 L 4.7274 8.4448 124.7147 53.9361 44.2468 175.0125 22 V 4.7441 8.8389 126.5487 61.1242 34.1295 173.6142 23 E 4.9415 9.6328 130.3243 55.1224 31.2355 174.4301 24 I 4.7931 9.0275 128.6486 59.6923 39.7147 174.5313 25 Q 4.9644 8.9935 126.6134 53.9950 31.3523 174.7004 26 L 4.6459 8.6449 123.8561 51.8484 45.4743 174.5756 27 P 4.9023 0.0000 0.0000 63.1409 32.3266 175.8499 28 S 4.7553 9.0330 116.0980 57.6823 66.8278 173.1177 29 N 5.2068 9.6264 126.0735 50.8151 39.5087 172.8412 30 P 4.3656 0.0000 0.0000 64.9598 31.5981 178.7621 31 T 4.0834 7.9502 109.0185 63.9431 68.7993 175.4328 32 T 4.1757 8.0122 111.7762 62.2012 69.1852 176.0902 33 G 4.1716 8.3485 110.9335 45.5582 0.0000 173.4217 34 F 4.0733 7.9946 117.8781 57.3501 39.9034 174.6048 35 A 4.5371 8.3782 122.1694 50.9346 23.3068 174.5978 36 W 5.1240 9.0642 118.9845 56.2511 30.2777 176.4211 37 Y 5.0796 8.9707 120.8787 56.2831 42.5286 174.9256 38 F 5.0150 9.1811 120.7250 56.9680 40.6508 175.2158 39 E 4.3417 8.9097 119.8994 57.8888 29.7318 178.0936 40 G 3.8826 8.7785 109.6945 44.8891 0.0000 173.2847 41 G 3.4616 8.0015 106.6396 47.0669 0.0000 173.3997 42 T 4.8776 7.8339 111.3643 60.0240 70.7466 173.7827 43 K 4.8920 8.8622 123.0096 56.8432 32.8476 177.0973 44 E 4.4256 8.1560 119.2179 55.1260 30.3426 176.4896 45 S 3.3326 8.2961 116.2024 57.7509 62.7861 172.9796 46 P 4.1244 0.0000 0.0000 64.9019 31.5113 175.9457 47 N 4.5591 7.3618 116.1925 51.6562 39.8157 174.4105 48 E 4.1627 8.7009 125.5032 58.2007 29.7923 178.8546 49 S 4.2877 7.7164 112.5130 60.1656 63.9501 175.1700 50 M 4.2786 7.9309 121.4232 56.9154 32.5413 175.6816 51 F 5.4222 7.0224 111.4141 55.9330 41.3008 172.9503 52 T 4.6820 9.0595 110.4169 60.0482 72.0792 172.9986 53 V 5.1560 8.3227 121.2643 61.4808 34.6765 174.2558 54 E 5.1067 9.4862 126.9221 54.7645 32.9118 174.6017 55 N 5.2896 8.4479 117.7416 51.6631 40.8379 173.4015 56 K 4.4645 8.6560 120.1491 55.3627 35.9105 173.7685 57 Y 5.0258 8.4364 127.3460 56.3405 41.1211 173.8924 58 F 4.6723 8.3352 125.5329 54.6302 41.3648 173.5148 59 P 4.8186 0.0000 0.0000 60.8919 32.5843 174.5766 60 P 4.4382 0.0000 0.0000 62.5978 31.9384 177.3089 61 D 4.4445 8.7180 120.9304 57.3925 40.9480 178.2274 62 S 4.1255 8.0669 112.6087 59.2611 63.1225 174.9131 63 K 3.9235 7.9616 117.9006 56.9129 30.3054 175.3193 64 L 4.2186 7.7998 119.9691 54.0457 42.1073 176.7713 65 L 4.1639 8.3872 123.3974 56.4515 41.9161 177.8244 66 G 3.9327 9.0630 111.0223 45.2392 0.0000 173.0710 67 A 4.4158 7.5639 122.3768 50.9857 19.6551 177.9028 68 G 4.0956 8.5768 110.6979 45.4154 0.0000 173.8617 69 G 4.3625 9.1047 108.4275 45.8595 0.0000 172.1940 70 T 5.3275 8.6383 117.2164 60.5581 71.1852 173.2158 71 E 5.1094 9.6496 128.6170 55.7359 31.8145 174.6769 72 H 5.3670 9.3882 121.2182 54.1119 31.7755 173.0909 73 F 5.1331 9.4472 122.5010 56.0615 41.5997 174.2880 74 H 5.4063 9.6283 121.7193 54.4266 30.6075 173.7611 75 V 4.8841 8.9578 124.9775 61.5194 33.6269 174.4362 76 T 5.2498 8.9311 124.9114 60.8378 71.1662 173.7501 77 V 4.1317 8.4959 127.0477 62.9762 32.3030 176.2575 78 K 4.8366 9.3176 126.1882 56.6053 33.8245 176.2772 79 A 4.7017 7.8415 120.4103 49.7512 22.2968 175.4896 80 A 4.2151 8.4312 122.8746 52.4515 19.2721 177.0359 81 G 4.1578 7.5602 106.2944 43.5502 0.0000 172.7462 82 T 4.9088 7.9195 117.1640 62.4086 69.6246 174.0886 83 H 5.0725 9.1580 124.9129 53.8536 31.2342 174.0012 84 A 4.2492 8.7372 125.4603 51.1544 19.7987 176.6066 85 V 4.2182 8.2960 123.6093 61.4592 33.1958 174.2748 86 N 5.3310 9.0241 125.9343 51.5545 40.5538 174.2022 87 L 5.0539 9.1238 123.9170 53.2049 45.9574 175.8685 88 T 5.2147 8.9283 116.8730 62.1564 73.0416 172.5874 89 Y 4.4482 8.6016 128.0712 56.7474 39.1175 174.3435 90 M 4.7502 8.7071 123.7668 53.9749 35.4914 174.2724 91 R 3.7378 7.3597 118.9533 53.8175 30.6844 176.2815 92 P 3.7715 0.0000 0.0000 64.9297 31.3855 177.4367 93 W 4.3598 7.3080 114.2292 57.9801 28.6494 176.6431 94 T 4.0745 7.2157 115.4251 63.1155 69.4354 175.4879 95 G 3.7431 7.5958 107.6462 43.6193 0.0000 170.7074 96 P 4.4845 0.0000 0.0000 62.6083 32.2288 175.4673 97 S 4.6567 8.8631 114.0018 57.3036 65.9919 174.2504 98 H 4.3437 8.9498 114.6535 58.0837 28.3462 175.6834 99 D 4.7521 7.0888 118.2418 53.8671 40.9101 176.5280 100 S 4.2821 7.6756 116.8000 58.2058 63.4779 173.7140 101 E 4.2687 8.7124 126.0507 56.3667 30.5011 175.5654 102 R 5.5079 8.7593 124.5005 54.5449 34.2200 174.6375 103 F 5.0105 9.4831 122.9750 56.9755 42.9654 173.5387 104 T 5.4389 9.0342 121.9711 60.3791 72.4172 173.2667 105 V 4.5591 7.6994 123.5798 59.9978 35.2664 173.6040 106 Y 4.7841 8.7591 120.2157 56.4080 40.5082 174.6949 107 L 4.9049 9.0103 124.6482 53.0056 43.9639 175.9236 108 K 4.6745 9.1738 127.9812 55.3591 32.9251 175.0278 109 A 5.7753 9.0127 129.9441 49.5588 22.1701 175.8701 110 N 4.5869 8.4315 116.8396 53.6400 39.4746 174.5607 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.29 4.38 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.52 0.00 2 S 8.18 4.77 0.00 4.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 H 9.62 5.04 0.00 3.10 3.16 0.00 5.75 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.60 5.00 0.00 1.54 1.63 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.39 7.81 5 V 9.30 4.56 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 1.01 0.00 0.00 6 T 8.33 5.06 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 7 K 8.59 3.84 0.00 1.65 1.81 0.00 2.06 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.49 7.81 8 A 7.46 4.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 H 8.30 4.71 0.00 3.50 3.37 0.00 5.83 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.02 4.00 0.00 2.96 2.76 0.00 0.00 7.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 G 9.12 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.14 4.30 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.38 5.04 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 14 L 8.92 4.71 0.00 1.55 1.47 0.90 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.41 4.86 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 16 V 8.78 4.62 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.91 0.00 0.00 17 A 8.70 4.87 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.32 3.76 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.94 0.00 0.00 19 G 9.37 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.13 4.35 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.29 0.00 21 L 8.44 4.73 0.00 1.74 1.52 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.84 4.74 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.88 0.00 0.00 23 E 9.63 4.94 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 24 I 9.03 4.79 1.91 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.46 0.00 0.00 25 Q 8.99 4.96 0.00 1.74 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.76 0.00 0.00 0.00 0.00 0.00 1.67 2.07 0.00 26 L 8.64 4.65 0.00 0.84 0.69 -0.85 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.90 0.00 1.94 1.99 0.00 3.66 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 28 S 9.03 4.76 0.00 4.37 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 9.63 5.21 0.00 2.82 2.80 0.00 0.00 6.67 8.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.37 0.00 2.10 1.94 0.00 3.80 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.00 0.00 31 T 7.95 4.08 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 32 T 8.01 4.18 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 33 G 8.35 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 F 7.99 4.07 0.00 2.20 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.38 4.54 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 9.06 5.12 0.00 3.43 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 8.97 5.08 0.00 2.91 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 F 9.18 5.02 0.00 3.39 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.91 4.34 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 40 G 8.78 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 T 7.83 4.88 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 43 K 8.86 4.89 0.00 2.01 2.22 0.00 1.92 0.00 0.00 1.97 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.68 1.53 7.81 44 E 8.16 4.43 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 45 S 8.30 3.33 0.00 3.50 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.12 0.00 1.94 2.04 0.00 2.97 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 47 N 7.36 4.56 0.00 2.52 2.37 0.00 0.00 7.07 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.70 4.16 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.13 0.00 49 S 7.72 4.29 0.00 3.90 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 M 7.93 4.28 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 51 F 7.02 5.42 0.00 3.19 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 9.06 4.68 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 53 V 8.32 5.16 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 1.27 0.00 0.00 54 E 9.49 5.11 0.00 1.99 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 55 N 8.45 5.29 0.00 1.97 2.38 0.00 0.00 5.79 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.66 4.46 0.00 1.64 1.46 0.00 1.34 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.33 1.00 7.81 57 Y 8.44 5.03 0.00 3.11 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 8.34 4.67 0.00 2.83 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.82 0.00 2.13 2.24 0.00 3.23 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.84 0.00 60 P 0.00 4.44 0.00 2.27 2.45 0.00 3.81 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.28 0.00 61 D 8.72 4.44 0.00 2.69 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.07 4.13 0.00 3.99 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.96 3.92 0.00 1.98 1.97 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.60 7.81 64 L 7.80 4.22 0.00 1.75 1.61 0.94 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.39 4.16 0.00 1.65 1.64 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 66 G 9.06 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.56 4.42 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.58 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 9.10 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.64 5.33 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 71 E 9.65 5.11 0.00 2.17 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.66 0.00 72 H 9.39 5.37 0.00 3.13 3.24 0.00 5.59 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 9.45 5.13 0.00 2.90 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 H 9.63 5.41 0.00 3.09 3.29 0.00 5.60 0.00 0.00 0.00 0.00 6.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.96 4.88 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.07 0.00 0.00 76 T 8.93 5.25 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 77 V 8.50 4.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.94 0.00 0.00 78 K 9.32 4.84 0.00 1.84 1.83 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.60 1.52 7.81 79 A 7.84 4.70 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.43 4.22 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 7.56 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.92 4.91 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 83 H 9.16 5.07 0.00 2.98 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.74 4.25 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.30 4.22 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.31 0.00 0.00 86 N 9.02 5.33 0.00 2.72 2.75 0.00 0.00 6.96 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 9.12 5.05 0.00 1.52 1.62 -0.04 -1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 88 T 8.93 5.21 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 89 Y 8.60 4.45 0.00 1.43 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 M 8.71 4.75 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.78 0.00 91 R 7.36 3.74 0.00 0.67 0.66 0.00 2.56 0.00 0.00 2.93 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.50 0.00 92 P 0.00 3.77 0.00 1.91 1.32 0.00 2.85 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.83 0.00 93 W 7.31 4.36 0.00 3.34 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.22 4.07 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 95 G 7.60 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.48 0.00 2.21 2.07 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.35 0.00 97 S 8.86 4.66 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 H 8.95 4.34 0.00 3.29 3.49 0.00 5.70 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 7.09 4.75 0.00 2.57 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 7.68 4.28 0.00 4.01 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.71 4.27 0.00 2.03 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.47 0.00 102 R 8.76 5.51 0.00 1.78 1.88 0.00 3.26 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 103 F 9.48 5.01 0.00 2.79 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 T 9.03 5.44 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 105 V 7.70 4.56 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.97 0.00 0.00 106 Y 8.76 4.78 0.00 2.89 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 9.01 4.90 0.00 1.49 1.55 0.73 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 108 K 9.17 4.67 0.00 1.81 1.85 0.00 1.56 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.37 7.81 109 A 9.01 5.78 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 N 8.43 4.59 0.00 2.55 2.66 0.00 0.00 6.83 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00